magnesium;propan-2-yl hypochlorite;dichloride

C3H7Cl3MgO — CID 162306203

IUPACmagnesium;propan-2-yl hypochlorite;dichloride
SMILESCC(C)OCl.[Cl-].[Cl-].[Mg+2]
InChIInChI=1S/C3H7ClO.2ClH.Mg/c1-3(2)5-4;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyAKLRSPMRVBZGBI-UHFFFAOYSA-L
MW189.75 g/mol
LogP-4.81
Rot. Bonds1

About magnesium;propan-2-yl hypochlorite;dichloride

magnesium;propan-2-yl hypochlorite;dichloride (PubChem CID 162306203) has the molecular formula C3H7Cl3MgO and a molecular weight of 189.75 g/mol. Its IUPAC name is magnesium;propan-2-yl hypochlorite;dichloride.

Molecular Properties

Compound Namemagnesium;propan-2-yl hypochlorite;dichloride
PubChem CID162306203
Molecular FormulaC3H7Cl3MgO
Molecular Weight189.75 g/mol
Exact Mass187.94
IUPAC Namemagnesium;propan-2-yl hypochlorite;dichloride
SMILESCC(C)OCl.[Cl-].[Cl-].[Mg+2]
InChIInChI=1S/C3H7ClO.2ClH.Mg/c1-3(2)5-4;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyAKLRSPMRVBZGBI-UHFFFAOYSA-L
XLogP-4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.75
LogP ≤ 5-4.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of magnesium;propan-2-yl hypochlorite;dichloride?
The IUPAC name of magnesium;propan-2-yl hypochlorite;dichloride (CID 162306203) is magnesium;propan-2-yl hypochlorite;dichloride.
What is the SMILES notation for magnesium;propan-2-yl hypochlorite;dichloride?
The canonical SMILES for magnesium;propan-2-yl hypochlorite;dichloride is CC(C)OCl.[Cl-].[Cl-].[Mg+2].
What is the InChIKey of magnesium;propan-2-yl hypochlorite;dichloride?
The InChIKey is AKLRSPMRVBZGBI-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H7ClO.2ClH.Mg/c1-3(2)5-4;;;/h3H,1-2H3;2*1H;/q;;;+2/p-2.
What are the key properties of magnesium;propan-2-yl hypochlorite;dichloride?
magnesium;propan-2-yl hypochlorite;dichloride has a molecular weight of 189.75 g/mol, XLogP of -4.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;propan-2-yl hypochlorite;dichloride is sourced from PubChem (CID 162306203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).